4-Benzoylbenzoic acid
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4-Benzoylbenzoic acid
structure -
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CAS No:
611-95-0
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Formula:
C14H10O3
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Chemical Name:
4-Benzoylbenzoic acid
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Synonyms:
Benzoic acid,4-benzoyl-;Benzoic acid,p-benzoyl-;4-Benzoylbenzoic acid;p-Benzoylbenzoic acid;4-Carboxybenzophenone;Benzophenone-4-carboxylic acid;p-Carboxybenzophenone;NSC 37115
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CAS No:
Characteristics
54.4
3
1.2022 (rough estimate)
199 °C
203-204 °C @ Press: 1 Torr
219.3ºC
It is soluble in water (partly).
Safety Information
NONH for all modes of transport
3
R36/37/38
S22-S24/25
DG3650000
Xi:Irritant;
Stable. Incompatible with strong bases, strong oxidizing agents.
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:226.23
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:226.062994177
Monoisotopic Mass:226.062994177
Topological Polar Surface Area:54.4
Heavy Atom Count:17
Complexity:284
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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